Chemical ID: 5080822

c1ccc(cc1)C=CC(=O)O
Chemical ID:
5080822
Name [?]:
cinnamic acid
SMILES [?]:
c1ccc(cc1)C=CC(=O)O
InChi [?]:
InChI=1/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,7,8,4,9,10,11/E:(2,3)(4,5)(10,11)/rA:11nCCCCCCCCCOO/rB:s1;d2;s3;d4;d1s5;s4;w7;s8;d9;s9;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H8O2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.6753
Area:300.271
Solvation:-1.83147
Coulombic:-28.3808
Bond Count [?]
All:11
Single:6
Double:5
Rotors:2
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:148.159
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.91
LogP (Chemaxon):2.15

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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